AG000PBZ

1196154-93-4 | 2-Pyridinecarboxylic acid, 4-bromo-5-methyl-

AG000PBZ

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CAS Number	1196154-93-4
Catalog Number	AG000PBZ(AGN-PC-0WAMXO)
Chemical Name	2-Pyridinecarboxylic acid, 4-bromo-5-methyl-
IUPAC Name	4-bromo-5-methylpyridine-2-carboxylic acid
InChI	InChI=1S/C7H6BrNO2/c1-4-3-9-6(7(10)11)2-5(4)8/h2-3H,1H3,(H,10,11)
InChI Key	QBHUWQKVSFENQT-UHFFFAOYSA-N
MDL Number	MFCD13190305
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
SMILES	BrC1=CC(=NC=C1C)C(=O)O
Synonyms	4-Bromo-5-methylpicolinic acid, 1196154-93-4, 4-bromo-5-methylpyridine-2-carboxylic acid, 4-BROMO-5-METHYL-PYRIDINE-2-CARBOXYLIC ACID, AK137974, 2-Pyridinecarboxylic acid, 4-bromo-5-methyl-, SCHEMBL232024, KS-00000QXZ, DTXSID60735467, MFCD13190305, ZINC88189923, AKOS022173641, AB70164, CS-W007217, DS-5934, FCH1326089, DA-18049, SC-19637, AJ-128162, AX8242687, FT-0716448, 4-BROMO-5-METHYLPYRIDIN-2-CARBOXYLIC ACID, 4-Bromo-5-methyl-2-pyridinecarboxylic acid, AldrichCPR,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.958g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.034g/mol
Monoisotopic Mass	214.958g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number